Home Other Building Blocks 2'-Methylpropiophenone

2'-Methylpropiophenone

CAS No.:
2040-14-4
Catalog Number:
AG00298G
Molecular Formula:
C10H12O
Molecular Weight:
148.2017
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$58
- +
5g
98%
In Stock USA
United States
$134
- +
10g
98%
In Stock USA
United States
$213
- +
25g
98%
In Stock USA
United States
$422
- +
Product Description
Catalog Number:
AG00298G
Chemical Name:
2'-Methylpropiophenone
CAS Number:
2040-14-4
Molecular Formula:
C10H12O
Molecular Weight:
148.2017
MDL Number:
MFCD05663689
IUPAC Name:
1-(2-methylphenyl)propan-1-one
InChI:
InChI=1S/C10H12O/c1-3-10(11)9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3
InChI Key:
VQHKICGSBBPFFJ-UHFFFAOYSA-N
SMILES:
CCC(=O)c1ccccc1C
NSC Number:
100176
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.089g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.205g/mol
Monoisotopic Mass:
148.089g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
13C and 1H nuclear magnetic resonance of methyl-substituted acetophenones and methyl benzoates: steric hindrance and inhibited conjugation. Magnetic resonance in chemistry : MRC 20041001
Properties